SCHEMBL3063266

SCHEMBL3063266

CCCCS(=O)(=O)N1CCN(c2nc(Cc3ccc(F)cc3)ns2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
NR3C1 P04150 1/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 2/20 0.40
GLA P06280 1/20 0.40
POLB P06746 1/20 0.39
LMNA P02545 3/20 0.39
NAAA Q02083 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR6 P50406 1/20 0.37
CNR1 P21554 1/20 0.37
HSD17B10 Q99714 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3054896 0.96 L3MBTL1 (0.42) L3MBTL1NR3C1MAPK1KDM4EGLA
SCHEMBL2009622 0.90 CNR1 (0.45) MAPK1KDM4EGLAPOLBLMNA
SCHEMBL2012201 0.89 CNR1 (0.43) L3MBTL1MAPK1KDM4ELMNAALDH1A1
SCHEMBL3062785 0.88 MAPK1 (0.38) L3MBTL1MAPK1POLBLMNASMN1; SMN2
SCHEMBL2001119 0.86 CNR1 (0.44) MAPK1KDM4EGLAPOLBLMNA
SCHEMBL3055027 0.86 CNR1 (0.44) MAPK1KDM4EGLAPOLBLMNA
SCHEMBL3065311 0.85 CNR1 (0.40) L3MBTL1MAPK1KDM4ELMNAALDH1A1
SCHEMBL3062246 0.85 MAPK1 (0.39) L3MBTL1MAPK1POLBLMNASMN1; SMN2
SCHEMBL3046032 0.84 MMP13 (0.42) L3MBTL1MAPK1LMNASMN1; SMN2ALDH1A1
SCHEMBL3053820 0.83 MMP13 (0.40) L3MBTL1MAPK1LMNASMN1; SMN2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 L3MBTL1 791/4885NR3C1 809/4885MAPK1 1449/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 L3MBTL1 791/4885NR3C1 809/4885MAPK1 1449/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 L3MBTL1 791/4885NR3C1 809/4885MAPK1 1449/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.